(E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine

C17H17FN2 — CID 19368641

IUPAC(E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine
SMILESCCc1ccc(/C=N/N=C/c2ccc(C)cc2)c(F)c1
InChIInChI=1S/C17H17FN2/c1-3-14-8-9-16(17(18)10-14)12-20-19-11-15-6-4-13(2)5-7-15/h4-12H,3H2,1-2H3/b19-11+,20-12+
InChIKeyJQDJUTQDVHPWFQ-AYKLPDECSA-N
MW268.33 g/mol
LogP4.15
Rot. Bonds4

About (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine

(E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine (PubChem CID 19368641) has the molecular formula C17H17FN2 and a molecular weight of 268.33 g/mol. Its IUPAC name is (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine.

Molecular Properties

Compound Name(E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine
PubChem CID19368641
Molecular FormulaC17H17FN2
Molecular Weight268.33 g/mol
Exact Mass268.14
IUPAC Name(E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine
SMILESCCc1ccc(/C=N/N=C/c2ccc(C)cc2)c(F)c1
InChIInChI=1S/C17H17FN2/c1-3-14-8-9-16(17(18)10-14)12-20-19-11-15-6-4-13(2)5-7-15/h4-12H,3H2,1-2H3/b19-11+,20-12+
InChIKeyJQDJUTQDVHPWFQ-AYKLPDECSA-N
XLogP4.15
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.33
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-fluoro-4-propylphenyl)methylideneamino]-1-(4-methylphenyl)methanimine
CID 54528266
(E)-N-[(E)-(4-butyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine
CID 19368295
N-[(2-fluoro-4-methoxyphenyl)methylideneamino]-1-(4-methylphenyl)methanimine
CID 54221747
N-[(3,4-difluorophenyl)methylideneamino]-1-[4-(4-ethyl-2-fluorophenyl)phenyl]methanimine
CID 54129002
(E)-N-[(E)-(4-butyl-2-fluorophenyl)methylideneamino]-1-(4-chlorophenyl)methanimine
CID 19368363
(E)-N-[(E)-(2-fluoro-4-propylphenyl)methylideneamino]-1-(4-methoxyphenyl)methanimine
CID 19368935
(E)-N-[(E)-(4-ethyl-3,5-difluorophenyl)methylideneamino]-1-(4-ethylphenyl)methanimine
CID 19368686
(E)-N-[(E)-(4-butyl-2-fluorophenyl)methylideneamino]-1-[4-(trifluoromethyl)phenyl]methanimine
CID 19368380
(E)-N-[(E)-(2,6-difluoro-4-methylphenyl)methylideneamino]-1-(4-methylphenyl)methanimine
CID 19368335
(E)-N-[(E)-(2,6-difluoro-4-methylphenyl)methylideneamino]-1-(4-propylphenyl)methanimine
CID 19368938
N-[(4-ethyl-2-fluorophenyl)methylideneamino]aniline
CID 169381828
(E)-1-(4-methylphenyl)-N-[(E)-(4-prop-2-enylphenyl)methylideneamino]methanimine
CID 19368603

Frequently Asked Questions

What is the IUPAC name of (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine?
The IUPAC name of (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine (CID 19368641) is (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine.
What is the SMILES notation for (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine?
The canonical SMILES for (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine is CCc1ccc(/C=N/N=C/c2ccc(C)cc2)c(F)c1.
What is the InChIKey of (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine?
The InChIKey is JQDJUTQDVHPWFQ-AYKLPDECSA-N. The full InChI is InChI=1S/C17H17FN2/c1-3-14-8-9-16(17(18)10-14)12-20-19-11-15-6-4-13(2)5-7-15/h4-12H,3H2,1-2H3/b19-11+,20-12+.
What are the key properties of (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine?
(E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine has a molecular weight of 268.33 g/mol, XLogP of 4.15, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[(E)-(4-ethyl-2-fluorophenyl)methylideneamino]-1-(4-methylphenyl)methanimine is sourced from PubChem (CID 19368641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).